4-methoxyaniline; 4-[(4-methoxyphenyl)carbamoyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-methoxyaniline; 4-[(4-methoxyphenyl)carbamoyl]benzene-1,3-dicarboxylic acid Openeye Name: 4-methoxyaniline; 4-[(4-methoxyphenyl)carbamoyl]benzene-1,3-dicarboxylic acid CAS Name: 4-methoxyaniline; 4-[(4-methoxyanilino)-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-methoxyaniline; 4-[(4-methoxyphenyl)carbamoyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[(4-methoxyphenyl)carbamoyl]isophthalic acid; p-anisidine Formula: C23H22N2O7 MolecularWeight: 438.42998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N.COC1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N.COC1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C16H13NO6.C7H9NO/c1-23-11-5-3-10(4-6-11)17-14(18)12-7-2-9(15(19)20)8-13(12)16(21)22;1-9-7-4-2-6(8)3-5-7/h2-8H,1H3,(H,17,18)(H,19,20)(H,21,22);2-5H,8H2,1H3